0 B14R2.101 C1=CC=C(CCC2=NCCC2)C=C1 RT5931 [1,0,0,0,0,0|1,0,2]=4 1 B14R1.422 O=C(O)CCCCCC1=CC=CC=C1 JZ2782 [0,0,1,0,0,0|3,0,0]=4 2 B14R1.716 COC(=O)CCCCC1=CC=CC=C1 YH45184 [0,0,1,0,0,0|2,0,0]=3 3 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 RT3212 [0,0,1,0,0,0|3,0,0]=4 4 B14R1.818 CC(=O)OC(C)CCC1=CC=CC=C1 LQ3403 [0,0,1,0,0,0|2,0,1]=4 5 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 RT6827 [0,0,0,0,1,0|1,0,1]=3 6 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CS1 YH46889 [0,0,0,0,1,0|1,1,1]=4 7 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 RT6803 [0,0,0,0,1,0|1,0,1]=3 8 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CS1 YH66520 [0,0,0,0,1,0|1,1,1]=4 9 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 YH24604 [0,0,0,0,1,0|1,1,1]=4 10 B16R2.2832 O=C1OCC(COCC2=CC=CC=C2)O1 RT7879 [0,0,0,0,0,1|2,0,0]=3 11 B13R1.28 NCCCCCCC1=CC=CC=C1 RT3206 [1,0,1,0,0,0|1,0,1]=4 12 B13R1.337 O=C(O)CCCCC1=CC=CC=C1 HL2170 [1,0,1,0,0,0|2,0,0]=4 13 B15R2.98 NC1=CC=C(CC2COC(=O)N2)C=C1 LT6237 [0,1,0,0,1,0|1,0,1]=4 14 B13R1.718 O=C(CCCC1=CC=CC=C1)O[Na] RT10772 [0,0,1,0,1,0|2,0,0]=4 15 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O RT5106 [0,0,1,0,1,0|2,0,0]=4 16 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O XJ6799 [0,0,1,0,1,0|2,0,0]=4 17 B13R2.10 NC1=N[C@H](C2=CC=CC=C2)CO1 RT4321 [0,0,0,0,2,0|0,0,0]=2 18 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SY0295 [0,0,0,0,2,0|1,0,1]=4 19 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 RT7870 [0,0,0,0,2,0|1,0,1]=4